Geometry & MOs

Info

ID:	175951
PubChem CID:	75971870
Reduced:	N2O5C28H28 (1)
Stoich.:	A2B5C28D28 (1)
Weight, g/mol:	480.23727
ΔH_f, kcal/mol:	-137.57
Dipole, Da:	5.35
IP(EA), eV:	-8.7(-0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,4-dimethoxyphenyl)-3-[2-(2-methoxyphenyl)-4,5-dimethyl-7-oxo-1,2,3,3a-tetrahydropyrazolo[1,5-a]pyrimidin-6-yl]propanamide

Drug info:

PubChemData

Smile

COC(=O)COC1=CC2=C(CC(N(C2)C(=O)CCC3=CC=CC=C3)C(=O)NC4=CC=CC=C4)C=C1

DOS

IR

Vibrations